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Application

Discovery Studio 1.0 Materials Studio 0.5302445302445302 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.038834951456310676 Amorphous Cell 0.22869471413160733 Blends 0.0010787486515641855 CASTEP 0.17583603020496225 CDOCKER 0.22761596548004315 CHARMm 0.3732470334412082 COMPASS 0.2837108953613808 COMPASS III 0.10140237324703344 COSMObase 0.002157497303128371 COSMOconf 0.008629989212513484 COSMOmic 0.0 COSMOperm 0.0 COSMOtherm 0.06040992448759439 Catalyst 0.11650485436893204 Classical Simulations 1.0 Crystallization 0.061488673139158574 DFTB Plus 0.0010787486515641855 DMol3 0.0744336569579288 DPD 0.002157497303128371 Discover 0.003236245954692557 Forcite 0.44660194174757284 GULP 0.006472491909385114 Kinetix 0.0 LUDI 0.002157497303128371 LibDock 0.0970873786407767 LigandFit 0.002157497303128371 MODELER 0.3333333333333333 Mesocite 0.002157497303128371 Mesoscale 0.004314994606256742 Morphology 0.012944983818770227 ONETEP 0.002157497303128371 Polymorph 0.0 Quantum Mechanics 0.25026968716289105 Reflex 0.04422869471413161 Semi-empirical 0.0010787486515641855 Sorption 0.05177993527508091 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.9029126213592233 ZDOCK 0.037756202804746494

Year

2025 1.0 2026 0.5774032459425718 2027 0.0

Keywords

target 1.0 potential 0.35405536668285575 docking 0.3195726080621661 analysis 0.2447790189412336 visualization 0.2185526954832443 binding 0.12044681884409908 novel 0.10587663914521613 promising 0.10199125789218066 between 0.09227780475959203 activity 0.0840213695968917 therapeutic 0.07042253521126761 including 0.03593977659057795 cell 0.034968431277319086 strong 0.03205439533754249 stability 0.02962603205439534 protein 0.021369596891694997 development 0.015541525012141816 synthesized 0.014570179698882952 mechanism 0.011656143759106362 synthesis 0.007770762506070908 silico 0.0048567265662943174 vitro 0.0048567265662943174 effective 0.004371053909664886 inhibition 0.003399708596406022 interaction 0.0
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